Theoretical study of the adsorption of aromatic units on carbon allotropes including explicit (empirical) DFT dispersion corrections and implicitly dispersion-corrected functionals: The pyridine case
- Ramos-Berdullas, N.
- Pérez-Juste, I.
- Van Alsenoy, C.
- Mandado, M.
ISSN: 1463-9076
Argitalpen urtea: 2015
Alea: 17
Zenbakia: 1
Orrialdeak: 575-587
Mota: Artikulua